Structure of dense liquids at solid interfaces
- 15 March 1979
- journal article
- research article
- Published by AIP Publishing in The Journal of Chemical Physics
- Vol. 70 (6) , 3099-3105
- https://doi.org/10.1063/1.437798
Abstract
Detailed calculations of dense fluids of hard spheres, soft repulsive spheres and Lennard‐Jones molecules between hard, soft repulsive and attractive solid walls reveals a pronounced stratification of the fluid’s density profile. The calculations have been performed using the NVT Monte Carlo method with about 200 fluid molecules. The results indicate that a very significant role is played by the attractive component in the intermolecular potentials, which suggests that the usual hard‐sphere perturbation theories are not applicable in their present form.Keywords
This publication has 24 references indexed in Scilit:
- Solution of Ornstein-Zernike equation for wall-particle distribution functionJournal of Statistical Physics, 1976
- Density-functional theory of simple classical fluids. I. SurfacesPhysical Review A, 1976
- Model for density variation at a fluid surfaceJournal of Statistical Physics, 1976
- What is "liquid"? Understanding the states of matterReviews of Modern Physics, 1976
- Grand ensemble Monte Carlo calculation of the thermodynamic properties of a solid/vapour interfaceAustralian Journal of Chemistry, 1976
- Adsorption of fluids. Improved calculation of the density profileJournal of the Chemical Society, Faraday Transactions 2: Molecular and Chemical Physics, 1976
- Computer simulation of the gas/liquid surfaceFaraday Discussions of the Chemical Society, 1975
- Structure of the liquid/vapour and liquid/solid interfacesFaraday Discussions of the Chemical Society, 1975
- Quantum hard spheres in a channelPhysical Review A, 1974
- Thermodynamics of the effects of adsorption on interparticle forcesJournal of the Chemical Society, Faraday Transactions 2: Molecular and Chemical Physics, 1973